Phytochelatin 4

CAT: 0931-T81477-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T81477-02Size:50 mg

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CAS Number

99465-98-2

Target

Others

Related Pathways

Others

Purity

0.9598

Bioactivity

Phytochelatin 4 (PC 4) a glutathione derived peptide and heavy metal detoxifier/chelator consisting of 4 units of glu - cys and generated by PC synthase, is tolerant to Cd (cadmium) and is sequestered in vesicles after complexation with heavy metals.

Smiles

[C@H](C(N[C@@H](CCC(N[C@H](C(N[C@@H](CCC(N[C@H](C(NCC(O)=O)=O)CS)=O)C(O)=O)=O)CS)=O)C(O)=O)=O)(NC(CC[C@H](NC([C@@H](NC(CC[C@@H](C(O)=O)N)=O)CS)=O)C(O)=O)=O)CS

Molecular Formula

C34H53N9O18S4

Molecular Weight

1004.09

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Phytochelatin 4

Phytochelatin 4 is a phytochelatin that is a nonapeptide consisting of 4 units of gamma-Glu-Cys, with a glycyl unit at the C-terminus. It is an oligopeptide and a phytochelatin.

CAS Number	99465-98-2
PubChem CID	14704026
IUPAC Name	(2S)-2-amino-5-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Molecular Formula	C34H53N9O18S4
Molecular Weight	1004.1
XLogP	-7.8
Topological Polar Surface Area	449
Hydrogen Bond Donor Count	18
Hydrogen Bond Acceptor Count	23
Rotatable Bond Count	33
Heavy Atom Count	65
Formal Charge	0
Complexity	1760

SMILES

C(CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C(=O)O)N

InChI

InChI=1S/C34H53N9O18S4/c35-14(31(54)55)1-5-22(44)38-19(11-63)28(51)41-16(33(58)59)3-7-24(46)40-21(13-65)30(53)43-17(34(60)61)4-8-25(47)39-20(12-64)29(52)42-15(32(56)57)2-6-23(45)37-18(10-62)27(50)36-9-26(48)49/h14-21,62-65H,1-13,35H2,(H,36,50)(H,37,45)(H,38,44)(H,39,47)(H,40,46)(H,41,51)(H,42,52)(H,43,53)(H,48,49)(H,54,55)(H,56,57)(H,58,59)(H,60,61)/t14-,15-,16-,17-,18-,19-,20-,21-/m0/s1

InChIKey

RXJVIYXWFHKGJE-QKSWPAOXSA-N

Chemical Structure

2D Structure

CAS: 99465-98-2

CID: 14704026

Formula: C34H53N9O18S4

MW: 1004.1

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1004.1
XLogP3	-7.8
Hydrogen Bond Donor Count	18
Hydrogen Bond Acceptor Count	23
Rotatable Bond Count	33
Exact Mass	1003.23914057
Monoisotopic Mass	1003.23914057
Topological Polar Surface Area	449 Å²
Heavy Atom Count	65
Formal Charge	0
Complexity	1760
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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TN7704-01	Homo-phytochelatin
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T81475-01	Phytochelatin 5
T81472-01	Phytochelatin 6 TFA
T81478-01	Phytochelatin 3 TFA
T41109	Phytochelatin 2 (PC2)
T81474-01	Phytochelatin 5 TFA
T81480-01	Phytochelatin 2 (PC2) (TFA)
TN11346-01	4,4'-Diapo-ω, ω-carotene-4,4'-dial

Alternative Products

Catalog	Name
HY-P3323	Phytochelatin 6
HY-P3322-01	Phytochelatin 5
GTR19233639-01	Homo-phytochelatin
GTR19035064-01	Phytochelatin 4
GTR19035062	Phytochelatin 3
MBS5823130	Phytochelatin 3 TFA
HY-P2512	Phytochelatin 2 (PC2)
MBS5823128	Phytochelatin 4 TFA
HY-P3320A	Phytochelatin 3 (TFA)
HY-P3322A	Phytochelatin 5 (TFA)

Phytochelatin 4

Chemical Information

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